N-({4-[(4-chlorophenyl)methoxy]phenyl}methyl)-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-({4-[(4-chlorophenyl)methoxy]phenyl}methyl)-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
N-({4-[(4-chlorophenyl)methoxy]phenyl}methyl)-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0506 |
| Compound Name: | N-({4-[(4-chlorophenyl)methoxy]phenyl}methyl)-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 440.39 |
| Molecular Formula: | C19 H22 Cl N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCCSc1nnnn1C)Cc1ccc(cc1)OCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0648 |
| logD: | 1.1293 |
| logSw: | -3.6353 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.417 |
| InChI Key: | RRGBTUMQHCJITR-UHFFFAOYSA-N |